On 12-02-06 08:37 AM, wtempel wrote:
Hello,
here is a question about the EXPAND command in SFTOOLS, specifically
its effect on a free reflection flag. Do the flag values get copied to
newly generated reflections based on symmetry, for example in the case
of a P622 -> P6 expansion?
many thanks,
Wolfram Tempel
During expansion all data columns get copied as is, so Rfree flags will
be as well (the only exception are phase columns which are adjusted as
necessary when there are translational components to the
crystallographic symmetry).
Bart
